SCHEMBL10091915

SCHEMBL10091915

Cc1[nH]c(/C=C2\C(=O)Nc3ccc(Nc4cccc(NC(=O)c5ccccc5)c4)cc32)c(C)c1C(=O)NCCN1CCCC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.68
PDGFRB P09619 6/20 0.68
FGFR1 P11362 5/20 0.68
TLK2 Q86UE8 2/20 0.68
FLT3 P36888 4/20 0.61
AURKB Q96GD4 2/20 0.61
MET P08581 1/20 0.61
NTRK2 Q16620 1/20 0.55
KIT P10721 2/20 0.55
AURKA O14965 1/20 0.55
LCK P06239 1/20 0.55
KCNH2 Q12809 1/20 0.55
NTRK1 P04629 1/20 0.54
PDPK1 O15530 2/20 0.53
AKT2 P31751 2/20 0.53
PRKAA2 P54646 3/20 0.51
PRKAA1 Q13131 3/20 0.51
EGFR P00533 1/20 0.51
NEK2 P51955 1/20 0.51
MELK Q14680 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL393772 1.00 KDR (0.68) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL10091895 0.94 KDR (0.69) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL398245 0.94 KDR (0.69) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL394536 0.94 KDR (0.68) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL10091896 0.94 KDR (0.68) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL10091917 0.92 KDR (0.65) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL396165 0.92 KDR (0.65) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL10091897 0.91 KDR (0.64) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL397415 0.91 KDR (0.64) KDRPDGFRBFGFR1TLK2FLT3
SCHEMBL396422 0.90 FLT3 (0.69) KDRPDGFRBFGFR1TLK2FLT3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101608-B2 3-(4-Methyl-imidazol-1-yl)-N-{3-[2-oxo-3-(1H-pyrrol-2-ylmethylene)-2,3-dihydro-1H-indol-6-ylamino]-phenyl}-5-trifluoromethyl-benzamide; including benign and malignant proliferative disorders as well as diseases resulting from inappropriate activation of the immune and nervous systems IRM LLC, a Delware Limited Corporation (BM) 2012-01-24 US disclosed
US-8101608-B2 3-(4-Methyl-imidazol-1-yl)-N-{3-[2-oxo-3-(1H-pyrrol-2-ylmethylene)-2,3-dihydro-1H-indol-6-ylamino]-phenyl}-5-trifluoromethyl-benzamide; including benign and malignant proliferative disorders as well as diseases resulting from inappropriate activation of the immune and nervous systems IRM LLC, a Delware Limited Corporation (BM) 2012-01-24 US disclosed
US-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-11 US disclosed
US-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-09-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080221192-A1 Compounds and Compositions as Protein Kinase Inhibitors BMX, FRK, PTK2B KDR 204/4885PDGFRB 313/4885FGFR1 199/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.